Found 1 result

Search term: MF = 'C_{15}H_{21}DO_{3}'

ChemSpider 2D Image | 5-(2,5-Dimethylphenoxy)-2,2-dimethylpentan(~2~H)oic acid | C15H21DO3

5-(2,5-Dimethylphenoxy)-2,2-dimethylpentan(2H)oic acid

  • Molecular FormulaC15H21DO3
  • Average mass251.339 Da
  • Monoisotopic mass251.163177 Da
  • ChemSpider ID95554457
  • Non-standard isotope - Non-standard isotope


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5-(2,5-Dimethylphenoxy)-2,2-dimethylpentan(2H)oic acid [ACD/IUPAC Name]
5-(2,5-Dimethylphenoxy)-2,2-dimethylpentan(2H)säure [German] [ACD/IUPAC Name]
Acide 5-(2,5-diméthylphénoxy)-2,2-diméthylpentan(2H)oïque [French] [ACD/IUPAC Name]
Pentanoic acid-d, 5-(2,5-dimethylphenoxy)-2,2-dimethyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 394.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 141.6±18.1 °C
Index of Refraction: 1.512
Molar Refractivity: 71.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 137.10
ACD/KOC (pH 5.5): 690.52
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 2.19
ACD/KOC (pH 7.4): 11.03
Polar Surface Area: 47 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 239.7±3.0 cm3

Click to predict properties on the Chemicalize site






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